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canSAR2019562
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NAMES
    SMILES
    Cc1nn(C)cc1C(C(=O)NC1CCCCC1)N(C(=O)Cc1cccs1)c1ccc(C(C)C)cc1
    InChI
    InChI=1S/C28H36N4O2S/c1-19(2)21-12-14-23(15-13-21)32(26(33)17-24-11-8-16-35-24)27(25-18-31(4)30-20(25)3)28(34)29-22-9-6-5-7-10-22/h8,11-16,18-19,22,27H,5-7,9-10,17H2,1-4H3,(H,29,34)
    MOLECULAR FORMULA
    C28H36N4O2S
    CROSS REFERENCES
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    canSAR2019562

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.26
    AlogP 5.68
    HBond donors 1
    HBond acceptors 6
    Atoms 71
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2019562.